In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 17 | Yes |
Popular Name: 5-[(4aR,8aR)-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl]pentanoic 5-[(4aR,8aR)-2,3,4a,5,6,7,8,8a-o…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.87 | 7.52 | -56.92 | 1 | 4 | 0 | 54 | 241.331 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.87 | 5.31 | -44.26 | 0 | 4 | -1 | 53 | 240.323 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.87 | 5.54 | -39.65 | 2 | 4 | 1 | 51 | 242.339 | 5 | ↓ |